(phenylmethyl) (2S,4R)-4-[(3-iodanylphenyl)methyl]-4-methyl-5-oxidanylidene-2-phenyl-1,3-oxazolidine-3-carboxylate

Systemtic Name: (phenylmethyl) (2S,4R)-4-[(3-iodanylphenyl)methyl]-4-methyl-5-oxidanylidene-2-phenyl-1,3-oxazolidine-3-carboxylate Openeye Name: benzyl (2S,4R)-4-[(3-iodophenyl)methyl]-4-methyl-5-oxo-2-phenyl-oxazolidine-3-carboxylate CAS Name: (2S,4R)-4-[(3-iodophenyl)methyl]-4-methyl-5-oxo-2-phenyl-3-oxazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,4R)-4-[(3-iodophenyl)methyl]-4-methyl-5-oxo-2-phenyl-1,3-oxazolidine-3-carboxylate Traditional Name: (2S,4R)-4-(3-iodobenzyl)-5-keto-4-methyl-2-phenyl-oxazolidine-3-carboxylic acid benzyl ester Formula: C25H22INO4 MolecularWeight: 527.35095

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)OC(N1C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)CC4=CC(=CC=C4)I

Isomeric SMILES

C[C@]1(C(=O)O[C@H](N1C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)CC4=CC(=CC=C4)I

InChI

InChI=1S/C25H22INO4/c1-25(16-19-11-8-14-21(26)15-19)23(28)31-22(20-12-6-3-7-13-20)27(25)24(29)30-17-18-9-4-2-5-10-18/h2-15,22H,16-17H2,1H3/t22-,25+/m0/s1